SCHEMBL3842663

SCHEMBL3842663

CCCC(C)(Oc1ccc(CCCCOc2nn(C)c(=O)n(CCCC(F)(F)F)c2=O)cc1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.40
PPARG P37231 14/20 0.40
PPARD Q03181 8/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3842218 0.91 PPARA (0.36) PPARAPPARGPPARD
SCHEMBL3840865 0.90 PPARA (0.47) PPARAPPARGPPARD
SCHEMBL3841403 0.90 PPARA (0.43) PPARAPPARGPPARD
SCHEMBL3845812 0.89 PPARA (0.45) PPARAPPARGPPARD
SCHEMBL3869431 0.88 PPARA (0.41) PPARAPPARGPPARD
SCHEMBL3845856 0.88 PPARG (0.44) PPARAPPARGPPARD
SCHEMBL3841408 0.87 PPARA (0.41) PPARAPPARGPPARD
SCHEMBL3848566 0.87 PPARA (0.39) PPARAPPARGPPARD
SCHEMBL3286687 0.85 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL3842418 0.84 PPARA (0.39) PPARAPPARGPPARD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856065-B1 1,2,4-TRIAZINE DERIVATIVES, PREPARATION AND USE THEREOF IN HUMAN THERAPY PF MEDICAMENT (FR) 2009-11-11 EP claimed